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Sugi Predict / Compounds / SCHEMBL5219655

SCHEMBL5219655

SCHEMBL5219655

O=C(O)Oc1ccc(CCCN2C(=O)CC[C@@H]2CC[C@@H](O)Cc2cccc(OC(F)(F)F)c2)s1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 3/20 0.65
▸ PTGER3 P43115 2/20 0.61
▸ PTGER1 P34995 1/20 0.61
▸ PTGER2 P43116 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5215550 0.90 PTGER4 (0.80) PTGER4PTGER3PTGER1PTGER2
SCHEMBL4994497 0.90 PTGER4 (0.80) PTGER4PTGER3PTGER1PTGER2
SCHEMBL4994503 0.90 PTGER4 (0.80) PTGER4PTGER3PTGER1PTGER2
SCHEMBL5218204 0.88 PTGER1 (0.65) PTGER4PTGER3PTGER1
SCHEMBL4990561 0.83 PTGER4 (0.77) PTGER4PTGER3PTGER2
SCHEMBL4990556 0.83 PTGER4 (0.77) PTGER4PTGER3PTGER2
SCHEMBL4990604 0.79 PTGER4 (1.00) PTGER4PTGER3PTGER1PTGER2
SCHEMBL625968 0.79 PTGER4 (1.00) PTGER4PTGER3PTGER1PTGER2
SCHEMBL11885702 0.79 PTGER4 (1.00) PTGER4PTGER3PTGER1PTGER2
SCHEMBL4984716 0.78 PTGER4 (0.63) PTGER4PTGER3PTGER2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1339678-B1 EP4 RECEPTOR SELECTIVE AGONISTS IN THE TREATMENT OF OSTEOPOROSIS PFIZER PROD INC (US) 2007-09-26 — — EP claimed
EP-1487437-B1 USE OF SELECTIVE EP4 RECEPTOR AGONISTS FOR THE TREATMENT OF DISEASES PFIZER PROD INC (US) 2006-08-16 — — EP claimed